canSAR1643840
FEATURES
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NAMES
    SMILES
    C[C@H]1O[C@@H](OC2CC[C@]3(C=O)[C@H]4CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)CC2OC(C)(C)OC21
    InChI
    InChI=1S/C32H46O9/c1-18-27-24(40-28(2,3)41-27)14-26(38-18)39-20-5-10-30(17-33)22-6-9-29(4)21(19-13-25(34)37-16-19)8-12-32(29,36)23(22)7-11-31(30,35)15-20/h13,17-18,20-24,26-27,35-36H,5-12,14-16H2,1-4H3/t18-,20?,21-,22+,23-,24?,26+,27?,29-,30+,31+,32+/m1/s1
    MOLECULAR FORMULA
    C32H46O9
    CROSS REFERENCES
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    canSAR1643840
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight574.31
    AlogP3.58
    HBond donors2
    HBond acceptors9
    Atoms87
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1643840.